SCHEMBL6963135

SCHEMBL6963135

CCOC(=O)[C@H](CNC(=O)CNC(=O)C(CCC1CCN(C(=O)O)CC1)CCC1CCN(C(=O)OC(C)(C)C)CC1)NS(=O)(=O)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
STS P08842 2/20 0.48
GPR119 Q8TDV5 4/20 0.46
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
YAP1 P46937 3/20 0.42
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
F10 P00742 1/20 0.41
PLG P00747 1/20 0.41
PRSS1 P07477 1/20 0.41
BCHE P06276 2/20 0.40
ACHE P22303 2/20 0.40
TGFBR1 P36897 1/20 0.39
LMNA P02545 2/20 0.39
TP53 P04637 2/20 0.39
MAPT P10636 2/20 0.39
KAT7 O95251 1/20 0.39
KAT8 Q9H7Z6 1/20 0.39
THRB P10828 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6975405 0.94 GPR119 (0.45) STSGPR119KDM4EPKMYAP1
SCHEMBL7955983 0.93 YAP1 (0.42) STSGPR119KDM4EPKMYAP1
SCHEMBL7951214 0.91 TGFBR1 (0.44) GPR119KDM4EPKMTGFBR1
SCHEMBL6962633 0.89 MMP13 (0.49) GPR119KDM4EPKMITGB3ITGA2B
SCHEMBL6964219 0.88 ITGB3 (0.43) GPR119KDM4EPKMITGB3ITGA2B
SCHEMBL7955628 0.88 ALDH1A1 (0.42) STSGPR119KDM4EPKMYAP1
SCHEMBL6970413 0.87 BCHE (0.47) GPR119KDM4EPKMYAP1ITGB3
SCHEMBL6964258 0.87 MMP13 (0.50) GPR119KDM4EPKMTGFBR1LMNA
SCHEMBL6969634 0.87 ITGB3 (0.37) GPR119KDM4EPKMITGB3ITGA2B
SCHEMBL6975825 0.87 ITGB3 (0.44) GPR119KDM4EPKMITGB3ITGA2B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1098878-B1 BISPIPERIDINES AS ANTITHROMBOTIC AGENTS CEPHALON FRANCE (FR) 2003-12-17 EP disclosed
US-6333338-B1 ANTICOAGULANTS, CARDIOVASCULAR DISORDERS LABORATOIRE L. LAFON (FR) 2001-12-25 US disclosed
EP-1098878-A1 BISPIPERIDINES AS ANTITHROMBOTIC AGENTS LABORATOIRE L. LAFON (FR) 2001-05-16 EP disclosed
WO-2000003986-A1 BISPIPERIDINES AS ANTITHROMBOTIC AGENTS LABORATOIRE L. LAFON (FR) 2000-01-27 WO disclosed